4-chloranyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide Openeye Name: 4-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide CAS Name: 4-chloro-N-[3-(4-morpholin-4-iumyl)propyl]-2-nitrobenzamide IUPAC Name: 4-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-2-nitrobenzamide Traditional Name: 4-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzamide Formula: C14H19ClN3O4+ MolecularWeight: 328.77136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H18ClN3O4/c15-11-2-3-12(13(10-11)18(20)21)14(19)16-4-1-5-17-6-8-22-9-7-17/h2-3,10H,1,4-9H2,(H,16,19)/p+1